4-(4-butan-2-ylphenyl)sulfonyl-N-(2-methylpropyl)piperazine-1-carbothioamide

Systemtic Name: 4-(4-butan-2-ylphenyl)sulfonyl-N-(2-methylpropyl)piperazine-1-carbothioamide Openeye Name: N-isobutyl-4-(4-sec-butylphenyl)sulfonyl-piperazine-1-carbothioamide CAS Name: 4-(4-butan-2-ylphenyl)sulfonyl-N-(2-methylpropyl)-1-piperazinecarbothioamide IUPAC Name: 4-(4-butan-2-ylphenyl)sulfonyl-N-(2-methylpropyl)piperazine-1-carbothioamide Traditional Name: N-isobutyl-4-(4-sec-butylphenyl)sulfonyl-piperazine-1-carbothioamide Formula: C19H31N3O2S2 MolecularWeight: 397.59834

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=S)NCC(C)C

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=S)NCC(C)C

InChI

InChI=1S/C19H31N3O2S2/c1-5-16(4)17-6-8-18(9-7-17)26(23,24)22-12-10-21(11-13-22)19(25)20-14-15(2)3/h6-9,15-16H,5,10-14H2,1-4H3,(H,20,25)